fluoro(trihydroxy)boranuide

H3BFO3- — CID 23235824

IUPACfluoro(trihydroxy)boranuide
SMILESO[B-](O)(O)F
InChIInChI=1S/BFH3O3/c2-1(3,4)5/h3-5H/q-1
InChIKeyVBZAHDFWLQGAGF-UHFFFAOYSA-N
MW80.83 g/mol
LogP-1.63
Rot. Bonds

About fluoro(trihydroxy)boranuide

fluoro(trihydroxy)boranuide (PubChem CID 23235824) has the molecular formula H3BFO3- and a molecular weight of 80.83 g/mol. Its IUPAC name is fluoro(trihydroxy)boranuide.

Molecular Properties

Compound Namefluoro(trihydroxy)boranuide
PubChem CID23235824
Molecular FormulaH3BFO3-
Molecular Weight80.83 g/mol
Exact Mass81.02
IUPAC Namefluoro(trihydroxy)boranuide
SMILESO[B-](O)(O)F
InChIInChI=1S/BFH3O3/c2-1(3,4)5/h3-5H/q-1
InChIKeyVBZAHDFWLQGAGF-UHFFFAOYSA-N
XLogP-1.63
TPSA60.69 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50080.83
LogP ≤ 5-1.63
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of fluoro(trihydroxy)boranuide?
The IUPAC name of fluoro(trihydroxy)boranuide (CID 23235824) is fluoro(trihydroxy)boranuide.
What is the SMILES notation for fluoro(trihydroxy)boranuide?
The canonical SMILES for fluoro(trihydroxy)boranuide is O[B-](O)(O)F.
What is the InChIKey of fluoro(trihydroxy)boranuide?
The InChIKey is VBZAHDFWLQGAGF-UHFFFAOYSA-N. The full InChI is InChI=1S/BFH3O3/c2-1(3,4)5/h3-5H/q-1.
What are the key properties of fluoro(trihydroxy)boranuide?
fluoro(trihydroxy)boranuide has a molecular weight of 80.83 g/mol, XLogP of -1.63, 0 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for fluoro(trihydroxy)boranuide is sourced from PubChem (CID 23235824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).